ID: 89524
SMILES:C1CC=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -14.368
InChIKey:CWSRYUYIYHHIIP-UHFFFAOYSA-N
ID: 89525
SMILES:C(CCc1cc(O)c2c(c1)C1C=C(C(=O)O)CCC1(C)CC2)(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.554
InChIKey:KZTWWPUCIVKEHL-UHFFFAOYSA-N
ID: 89526
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(O)CCC1C(CO)=C)O2)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.437
InChIKey:ZOBNZJNKUARAQY-UHFFFAOYSA-N
ID: 89527
SMILES:CCCCc1ccc2c(c1O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.751
InChIKey:VTQUXGAPYAWVKW-UHFFFAOYSA-N
ID: 89528
SMILES:c1(CCCCC)cc2c(c(O)c1C(O)=O)C(c1cc(O)c(O)cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -15.519
InChIKey:YZKQUIKPKNEQHI-UHFFFAOYSA-N
ID: 89529
SMILES:C(C)CCc1cc(O)c(CC=C(C)CCC=C(C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 286.459
CB1 binding score: -18.35
InChIKey:ONUSETJNXRTNAA-UHFFFAOYSA-N
ID: 89530
SMILES:CC(C)(C1C(c2c(O)cc(CCCCC)cc2O)OC(C)(C)C2C=CC(C)(O2)CCC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -15.507
InChIKey:UIZRYNZDUDSGPC-UHFFFAOYSA-N
ID: 89531
SMILES:C(C1(C)Oc2c(c(OC)cc(CCCCC)c2)C(=O)C1)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -15.162
InChIKey:QEXQZSMNWWTENM-UHFFFAOYSA-N
ID: 89532
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 89533
SMILES:C(C)(OC1C(C)=CC2C(C(C)(C)Oc3c2c(OC)ccc3)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.036
InChIKey:DIKSFXFFOAIDEV-UHFFFAOYSA-N
ID: 89534
SMILES:C=CC1CCC2(O)C1(C)CC1c3c(cc(CCCCC)cc3O1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.686
InChIKey:KANQZAMSKNOGLA-UHFFFAOYSA-N
ID: 89535
SMILES:C(CCCCC)c1cc2c(c(O)c1)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.929
InChIKey:KYRNNWMKJLBYHB-UHFFFAOYSA-N
ID: 89536
SMILES:CC(CCC=C(C)CO)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.748
InChIKey:UHRCXKCSCBRZGD-UHFFFAOYSA-N
ID: 89537
SMILES:C12c3c(O)cc(CCCCC)cc3OC(CCC1C(CCC=C(C)C)C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -15.929
InChIKey:XMBXADORRQNRCC-UHFFFAOYSA-N
ID: 89538
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 89539
SMILES:C1CC(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(CCCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.737
InChIKey:FDMWICAVSLTNMH-UHFFFAOYSA-N
ID: 89540
SMILES:c1(O)cc(CC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 89541
SMILES:C1C(CO)(C)C2C3(c4c(cc(CCCCC)cc4O)OC2C(O)C1O)CCC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.153
InChIKey:BYAFZBUTVIHEOI-UHFFFAOYSA-N
ID: 89542
SMILES:Oc1cc(CCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -21.105
InChIKey:SVTKBAIRFMXQQF-UHFFFAOYSA-N
ID: 89543
SMILES:C(c1cc(OC)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.693
InChIKey:NTKIABPKBTWCCW-UHFFFAOYSA-N
ID: 89544
SMILES:CCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.334
InChIKey:TXMLTLVZLMFEMH-UHFFFAOYSA-N